3-({1-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methyl]-1H-pyrazol-4-yl}carbamoyl)-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid
Chemical Structure Depiction of
3-({1-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methyl]-1H-pyrazol-4-yl}carbamoyl)-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid
3-({1-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methyl]-1H-pyrazol-4-yl}carbamoyl)-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid
Compound characteristics
| Compound ID: | Y503-1747 |
| Compound Name: | 3-({1-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methyl]-1H-pyrazol-4-yl}carbamoyl)-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid |
| Molecular Weight: | 373.41 |
| Molecular Formula: | C18 H23 N5 O4 |
| Smiles: | CCn1c(C)c(Cn2cc(cn2)NC(C2C(C3CCC2O3)C(O)=O)=O)cn1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.8766 |
| logD: | -0.6393 |
| logSw: | -1.8758 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.793 |
| InChI Key: | PPQOYZMMWPSTTC-UHFFFAOYSA-N |